Clustering data with hclust algorithm for (Study ST000893)

GC POSITIVE ION MODE (Analysis AN001455)
MetaboliteStructureF1F2F3
PutrescineME2287091.001.00NA
Siloxanes_R8ME228721NA1.001.01
SpermineME2287231.040.960.97
2-Hydroxyglutaric acidME2285941.060.980.97
C20 HydrocarbonME2286311.030.980.98
C22 hydrocarbonME2286331.041.000.97
DiethanolamineME2286461.040.990.97
Maleic acidME2286801.011.050.98
Threonic acid/erythronic acidME2287301.011.040.97
3-Aminoisobutyric acid/beta-AlanineME2285961.041.020.98
AsparagineME2286151.031.020.94
GlutamineME2286581.021.020.96
ArginineME2286140.990.971.04
Inosine 5^-monophosphateME2286731.000.961.05
Tryptamine/NorepinephrineME2287340.970.981.04
Siloxanes_R4ME2287170.970.991.05
Glyoxylic acidME2286640.981.001.05
Nonanoic acidME2286920.971.001.04
Fructose or similar ketohexoseME2286520.961.011.02
Inosine/AdenosineME2286740.971.011.02
Siloxanes_R6ME2287190.961.031.02
Siloxanes_R2ME2287150.971.021.02
6-Hydroxynicotinic acidME2286020.961.021.02
C19 hydrocarbonME2286300.961.021.03
Phosphoenolpyruvic acidME2287040.951.021.01
Siloxanes_R7ME2287200.941.031.02
N-Acetylneuraminic acidME2286881.020.981.03
Uric acidME2287391.010.981.01
C23 HydrocarbonME2286341.020.991.00
C25 hydrocarbonME2286361.010.991.00
Ketopentose-5-phosphateME2286761.010.991.00
Palmitoleic acidME2286981.020.981.00
Unknown-possibly propylene glycolME2287361.010.981.00
Xanthine (and/or Cytindine-5^-monophosphate)ME2287421.030.981.01
gamma-TocopherolME2286541.040.971.00
UracilME2287371.030.971.00
SpermidineME2287221.001.020.98
Nicotinic acidME2286911.001.020.98
SerineME2287131.001.020.98
C14 HydrocarbonME2286261.011.010.98
HydroxyprolinesME2286701.001.010.98
Dihydroxyacetone phosphateME2286471.011.020.97
Docosanoic acidME2286501.001.030.97
LysineME2286791.011.010.99
Isoleucine/LeucineME2286751.021.000.99
C21 HydrocarbonME2286321.011.000.99
HistidineME2286681.011.000.99
possibly Erythritol/TheitolME2287061.021.000.98
ValineME2287411.021.000.98
Gly-ProME2286591.021.010.97
PentitolsME2287011.021.010.98
Pyruvic acidME2287121.000.991.00
UridineME2287401.001.001.00
Sucrose and similar disaccharidesME2287281.001.001.00
Stearic acidME2287261.001.001.00
Siloxanes_R1ME2287141.001.001.00
Malic acidME2286811.001.001.00
CholesterolME2286391.001.001.00
C16 HydrocarbonME2286281.001.001.00
C10 hydrocarbonME2286221.001.001.00
beta-MonostearinME2286201.001.001.00
Aspartic acidME2286161.001.001.00
alpha-MonostearinME2286091.001.001.00
alpha-MonopalmitinME2286081.001.001.00
6-MethyluracilME2286031.001.001.00
AlanineME2286071.001.001.00
C24 HydrocarbonME2286351.001.000.99
Siloxanes_R3ME2287161.001.000.99
UreaME2287380.991.011.00
Succinic acidME2287270.991.011.00
SqualeneME2287240.991.011.00
Phosphoric acidME2287050.991.011.00
Pentadecanoic acid/HexadecanolME2287000.991.011.00
Pantothenic acidME2286990.991.011.00
NicotinamideME2286900.991.011.00
MSTFA artifactME2286840.991.011.00
Heptadecanoic acid/OctadecanolME2286650.991.011.00
Glucose and other aldohexosesME2286550.991.011.00
deuterated Myristic Acid (RTL std)ME2286450.991.011.00
Dehydroascorbic acid (possibly alpha-ketoglutarate)ME2286440.991.011.00
Citric acid/isocitric acidME2286400.991.011.00
CampesterolME2286370.991.011.00
C11 hydrocarbonME2286230.991.011.00
Benzoic acidME2286170.991.011.00
Adenosine/InosineME2286060.991.011.00
Adenosine-5-monophosphateME2286050.991.011.00
AdenineME2286040.991.011.00
1,5-AnhydroglucitolME2285920.991.011.00
2-Aminoadipic acidME2285930.991.011.00
Palmitic acidME2286971.001.011.00
MyoinositolME2286851.001.011.00
Lactic acidME2286771.001.011.00
Hexanoic acid (and/or Glycolic acid)ME2286661.001.011.00
2-HydroxypyridineME2285951.001.011.00
Glutamic acidME2286571.001.011.00
HomoserineME2286690.991.010.99
4-HydroxypyridineME2285990.991.010.99
beta-Hydroxybutyric acidME2286180.991.010.99
PyrophosphateME2287101.001.010.99
PhenylalanineME2287031.001.010.99
PhenolME2287021.001.010.99
Myristic acid or PentadecanolME2286871.001.010.99
MethionineME2286821.001.010.99
GlycineME2286621.001.010.99
CreatinineME2286411.001.010.99
C15 hydrocarbonME2286271.001.010.99
C13 hydrocarbonME2286251.001.010.99
C12 hydrocarbonME2286241.001.010.99
5-alpha-Coprostanol or similar oxysterolME2286001.001.010.99
Arachidic acid/ 1-HeneicosanolME2286121.001.010.99
3-Phosphoglyceric acidME2285980.981.030.99
beta-SitosterolME2286210.981.031.00
GlycerolME2286600.991.030.99
TyrosineME2287350.991.020.99
ThreonineME2287310.991.020.99
alpha-TocopherolME2286100.991.020.99
Glycolic acidME2286630.991.020.99
Pyrrole -2-carboxylic acidME2287110.981.010.99
Prunetin or similar isoflavoneME2287070.981.011.00
Siloxanes_R5ME2287180.981.011.00
3-Indolelactic acid/TryptophanME2285970.971.011.01
PseudouridineME2287080.981.011.01
N-Methylalanine/2-Aminobutanoic acid/N-EthylglycineME2286890.981.011.01
5^-Deoxy-5^-(methylthio) adenosineME2286010.981.011.01
HexitolsME2286670.981.011.01
Decanoic acidME2286420.971.021.01
Fumaric acidME2286530.981.021.01
1-Eicosanol/Nonadecanoic acidME2285911.000.981.02
StearamideME2287250.990.991.02
Methionine sulfoxideME2286830.990.991.02
EthanolamineME2286510.990.991.02
Glucose-6-phosphate or similarME2286560.990.991.02
O-MethylphosphateME2286930.981.001.01
p-Hydroxyphenyllactic acidME2286960.981.001.02
O-PhosphocolamineME2286940.981.001.02
Myoinositol-2-phosphateME2286860.981.001.02
Arachidonic acid (also Eicosapentaenoic acid)ME2286130.981.001.02
Docosahexaenoic acidME2286490.981.001.02
Tiglic acidME2287321.001.001.02
TaurineME2287291.001.001.01
Oleic acidME2286950.991.001.01
Linoleic acidME2286780.991.001.01
HypoxanthineME2286720.991.001.01
HypotaurineME2286710.991.001.01
Glycerol 1-phosphateME2286610.991.001.01
DisaccharideME2286480.991.001.01
Dehydroalanine (possibly from cysteine)ME2286430.991.001.01
beta-MonopalmitinME2286190.991.001.01
C17 hydrocarbonME2286290.991.001.01
Chenodeoxycholic acidME2286380.991.130.95
Aminomalonic acidME2286111.001.030.91
TrisME2287331.001.070.93

Factors:

F1Treatment:40mg/kg Sun
F2Treatment:50mg/kg Erl
F3Treatment:PBS Ctl
Data matrix
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